Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.42 |
| ▸ | KDM1A | O60341 | 9/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL30829412 | 0.91 | ESR2 (0.43) | CA1CA2CA7CA9CA14 | |
| SCHEMBL30829407 | 0.91 | ESR2 (0.43) | CA1CA2CA7CA9CA14 | |
| SCHEMBL7124159 | 0.85 | CA1 (0.46) | CA1CA2CA7CA9CA14 | |
| SCHEMBL28094298 | 0.85 | TSHR (0.41) | KDM1ATSHRNPSR1KDM4EMAPT | |
| Hydrochloric Acid SCHEMBL3534709 | 0.84 | CA1 (0.45) | CA1CA2CA7CA9CA14 | |
| SCHEMBL28146344 | 0.84 | TSHR (0.37) | KDM1ATSHRNPSR1KDM4EMAPT | |
| SCHEMBL29097871 | 0.83 | DRD2 (0.49) | KDM1ATSHRKDM4E | |
| SCHEMBL7694988 | 0.82 | TSHR (0.60) | TSHRNPSR1MAPT | |
| SCHEMBL30442509 | 0.82 | TSHR (0.60) | TSHRNPSR1MAPT | |
| SCHEMBL30829405 | 0.82 | TSHR (0.60) | TSHRNPSR1MAPT |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118290334-A | Preparation method of Lifeiste key intermediate | 上海医药工业研究院有限公司 | 2024-07-05 | — | — | CN | disclosed |
| WO-1999009980-A1 | METHOD FOR TREATING PAIN | ELI LILLY AND COMPANY (US) | 1999-03-04 | — | — | WO | disclosed |